Glycoside
...
GD005972

Name:
None

Formula:
C34H37O10N5

Smiles:
CC(=O)OC[C@@H]1O[C@H](n2cc(CN3C(=O)C(=Cc4ccc(N(C)C)cc4)c4ccccc43)nn2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:
CN(C)c1ccc(C=C2C(=O)N(CC3=C[N]N=N3)c3ccccc32)cc1.COC(C)=O

Sugarmoiety:
CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

Properties
HBA: 15 RingCount: 5
HBD: 0 FractionCSP3: 0.38
AlogP: 2.69 Num_rotatable_bonds: 10
MolWt: 675.7 Num_heavy_atoms: 49
TPSA: 168.69 NumAromaticRings: 3

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD04989
Formula: C20H18ON5

Smiles:
CN(C)c1ccc(C=C2C(=O)N(CC3=C[N]N=N3)c3ccccc32)cc1
HBA: 6 RingCount: 4
HBD: 0 FractionCSP3: 0.15
AlogP: 3.47 Num_rotatable_bonds: 4
MolWt: 344.4 Num_heavy_atoms: 26
TPSA: 62.37 NumAromaticRings: 2

Sugarmoiety
SD00012

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O